3-[2-[(3-methyl-1-naphthalen-1-yl-butyl)carbamoyl]-4-(pyridin-3-yloxymethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-[(3-methyl-1-naphthalen-1-yl-butyl)carbamoyl]-4-(pyridin-3-yloxymethyl)phenyl]propanoic acid Openeye Name: 3-[2-[[3-methyl-1-(1-naphthyl)butyl]carbamoyl]-4-(3-pyridyloxymethyl)phenyl]propanoic acid CAS Name: 3-[2-[[[3-methyl-1-(1-naphthalenyl)butyl]amino]-oxomethyl]-4-(3-pyridinyloxymethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[(3-methyl-1-naphthalen-1-ylbutyl)carbamoyl]-4-(pyridin-3-yloxymethyl)phenyl]propanoic acid Traditional Name: 3-[2-[[3-methyl-1-(1-naphthyl)butyl]carbamoyl]-4-(3-pyridyloxymethyl)phenyl]propionic acid Formula: C31H32N2O4 MolecularWeight: 496.59678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)COC4=CN=CC=C4)CCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)COC4=CN=CC=C4)CCC(=O)O

InChI

InChI=1S/C31H32N2O4/c1-21(2)17-29(27-11-5-8-23-7-3-4-10-26(23)27)33-31(36)28-18-22(12-13-24(28)14-15-30(34)35)20-37-25-9-6-16-32-19-25/h3-13,16,18-19,21,29H,14-15,17,20H2,1-2H3,(H,33,36)(H,34,35)